SCHEMBL29901513

SCHEMBL29901513

Fc1ccc(-c2cnc3c(F)n[nH]c3c2)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 11/20 0.44
GRIN1 Q05586 5/20 0.42
GRM4 Q14833 3/20 0.41
TRPA1 O75762 2/20 0.41
CACNA1B Q00975 1/20 0.40
PTPN11 Q06124 1/20 0.39
FYN P06241 1/20 0.39
NISCH Q9Y2I1 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30133031 0.87 TRPA1 (0.53) GRIN2BGRIN1TRPA1
SCHEMBL29901520 0.83 GRIN2B (0.44) GRIN2BGRIN1TRPA1
SCHEMBL29901458 0.82 GRIN2B (0.45) GRIN2BGRIN1TRPA1
SCHEMBL22774734 0.82 GRIN2B (0.43) GRIN2BGRIN1TRPA1
SCHEMBL29901460 0.79 GRIN2B (0.47) GRIN2BGRIN1TRPA1
SCHEMBL22774357 0.78 GRIN2B (0.48) GRIN2BGRIN1
SCHEMBL29525107 0.78 GRIN2B (0.48) GRIN2BGRIN1
SCHEMBL22775262 0.78 GRIN2B (0.46) GRIN2BGRIN1
SCHEMBL30133051 0.75 RAF1 (0.47) GRIN2BGRIN1CACNA1BFYNNISCH
SCHEMBL30176755 0.73 PRKD3 (0.58) GRIN2BGRIN1CACNA1BFYN

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230045960-A1 SUBSTITUTED HETEROAROMATIC PYRAZOLO-PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2023-02-16 US disclosed
US-11530210-B2 Substituted heteroaromatic pyrazolo-pyridines and their use as GLUN2B receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2022-12-20 US disclosed
US-20220274984-A1 SUBSTITUTED HETEROAROMATIC PYRAZOLO-PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2022-09-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230045960-A1 SUBSTITUTED HETEROAROMATIC PYRAZOLO-PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS GRIN2B, GRIN2A, GRIN2C GRIN2B 1/4885GRIN1 6/4885GRM4 20/4885
US-20220274984-A1 SUBSTITUTED HETEROAROMATIC PYRAZOLO-PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS GRIN2B, GRIN2A, GRIN2C GRIN2B 1/4885GRIN1 6/4885GRM4 20/4885
US-11530210-B2 Substituted heteroaromatic pyrazolo-pyridines and their use as GLUN2B receptor modulators GRIN2B, GRIN2A, GRIN2C GRIN2B 1/4885GRIN1 6/4885GRM4 20/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.